Geometry & MOs

Info

ID:	129990
PubChem CID:	51074495
Reduced:	N2O3C15H22 (1)
Stoich.:	A2B3C15D22 (1)
Weight, g/mol:	313.142641
ΔH_f, kcal/mol:	-83.48
Dipole, Da:	2.14
IP(EA), eV:	-8.34(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[methyl(1-phenylethyl)amino]methyl]-3-nitrobenzamide

Drug info:

PubChemData

Smile

COCCN1CCN(CC1)CC2=CC3=C(C=C2)OCO3

DOS

IR

Vibrations